4-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-6-methyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxidanylidene-butyl]-6-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxo-butyl]-6-methyl-1,4-benzoxazin-3-one CAS Name: 4-[4-(4-ethyl-1-piperazin-4-iumyl)-4-oxobutyl]-6-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[4-(4-ethylpiperazin-4-ium-1-yl)-4-oxobutyl]-6-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[4-(4-ethylpiperazin-4-ium-1-yl)-4-keto-butyl]-6-methyl-1,4-benzoxazin-3-one Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCCN2C(=O)COC3=C2C=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCCN2C(=O)COC3=C2C=C(C=C3)C

InChI

InChI=1S/C19H27N3O3/c1-3-20-9-11-21(12-10-20)18(23)5-4-8-22-16-13-15(2)6-7-17(16)25-14-19(22)24/h6-7,13H,3-5,8-12,14H2,1-2H3/p+1